Sodium ion → 1-(1,4-dioxaspiro[4.5]dec-8-yl)-3-[4-(2-pyrimidinyloxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Reaction equation
[CH3:22][C:23]1([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28][B:29]([c:30]2[cH:31][cH:32][c:33]([O:34][c:35]3[n:36][cH:37][cH:38][cH:39][n:40]3)[cH:41][cH:42]2)[O:43]1.[CH3:50][O:51][CH2:52][CH2:53][O:54][CH3:55].[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[O:1]1[CH2:2][CH2:3][O:4][C:5]12[CH2:6][CH2:7][CH:8]([n:11]1[n:12][c:13]([I:21])[c:14]3[c:15]1[n:16][cH:17][n:18][c:19]3[NH2:20])[CH2:9][CH2:10]2.[OH2:56].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[O:1]1[CH2:2][CH2:3][O:4][C:5]12[CH2:6][CH2:7][CH:8]([n:11]1[n:12][c:13](-[c:30]3[cH:31][cH:32][c:33]([O:34][c:35]4[n:36][cH:37][cH:38][cH:39][n:40]4)[cH:41][cH:42]3)[c:14]3[c:15]1[n:16][cH:17][n:18][c:19]3[NH2:20])[CH2:9][CH2:10]2Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-c683ebea6f4e457abb1db22fe0d7479e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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